AO-022/43453328
TL;DR: AO-022/43453328 (CAS 844652-97-7) is a chemical compound with molecular formula C28H30N4O4 and molecular weight 486.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-(3,4-dimethylbenzoyl)imino-11-methyl-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: AO-022/43453328, (Z)-ethyl 2-((3,4-dimethylbenzoyl)imino)-1-isobutyl-10-methyl-5-oxo-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, ethyl (2Z)-2-{[(3,4-dimethylphenyl)carbonyl]imino}-10-methyl-1-(2-methylpropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, ethyl 2-[(3,4-dimethylbenzoyl)imino]-1-isobutyl-10-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxylate
| Molecular Formula | C28H30N4O4 |
|---|---|
| Molecular Weight | 486.23 g/mol |
| LogP | 4.14826 |
| Topological Polar Surface Area | 95.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.2267 |
| Heavy Atoms | 36 |
| Complexity | 1643.9832 |
Chemical Identifiers
| CAS Number | 844652-97-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(N=C3C(=CC=CN3C2=O)C)N(C1=NC(=O)C4=CC(=C(C=C4)C)C)CC(C)C |
Product Overview
AO-022/43453328 (CAS 844652-97-7), with molecular formula C28H30N4O4 and molecular weight 486.23 g/mol. IUPAC: ethyl 6-(3,4-dimethylbenzoyl)imino-11-methyl-7-(2-methylpropyl)-2-oxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
Chemical Property Profile of AO-022/43453328
Property Insights of AO-022/43453328
The XLogP value of 4.14826 indicates that AO-022/43453328 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.03 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453328. Following Lipinski's Rule of Five, AO-022/43453328 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-022/43453328?
The CAS number of AO-022/43453328 is 844652-97-7.
What is the molecular formula of AO-022/43453328?
The molecular formula of AO-022/43453328 is C28H30N4O4.
What is the molecular weight of AO-022/43453328?
The molecular weight of AO-022/43453328 is 486.23 g/mol.
Where can I buy AO-022/43453328?
You can request a quote for AO-022/43453328 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453328?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453328 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.